Mol:LBF14000BC07
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 17 16 0 0 1 0 0 0 0 0999 V2000 | + | 17 16 0 0 1 0 0 0 0 0999 V2000 |
| − | -3.9676 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9676 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4699 2.4920 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.4699 2.4920 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -0.4699 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4699 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.5566 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.5566 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9676 3.2040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9676 3.2040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9676 1.7800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9676 1.7800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3510 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3510 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9400 2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9400 2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1540 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1540 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5651 1.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5651 1.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1540 1.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1540 1.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5651 0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5651 0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1540 -0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1540 -0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5651 -1.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5651 -1.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1540 -1.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1540 -1.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5651 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5651 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.1540 -3.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1540 -3.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 3 1 4 0 0 0 | + | 2 3 1 4 0 0 0 |
| − | 4 5 2 0 0 0 0 | + | 4 5 2 0 0 0 0 |
| − | 4 6 1 0 0 0 0 | + | 4 6 1 0 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 2 8 1 0 0 0 0 | + | 2 8 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 2 9 1 0 0 0 0 | + | 2 9 1 0 0 0 0 |
| − | 4 17 1 0 0 0 0 | + | 4 17 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF14000BC07 | + | ID LBF14000BC07 |
| − | FORMULA C15H30O2 | + | FORMULA C15H30O2 |
| − | EXACTMASS 242.22458020399998 | + | EXACTMASS 242.22458020399998 |
| − | AVERAGEMASS 242.3975 | + | AVERAGEMASS 242.3975 |
| − | SMILES CCCC(C)CCCCCCCCCC(O)=O | + | SMILES CCCC(C)CCCCCCCCCC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
17 16 0 0 1 0 0 0 0 0999 V2000
-3.9676 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4699 2.4920 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-0.4699 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5566 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9676 3.2040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9676 1.7800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3510 2.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9400 2.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1540 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5651 1.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1540 1.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5651 0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1540 -0.3560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5651 -1.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1540 -1.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5651 -2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1540 -3.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 4 0 0 0
4 5 2 0 0 0 0
4 6 1 0 0 0 0
1 7 1 0 0 0 0
2 8 1 0 0 0 0
7 8 1 0 0 0 0
2 9 1 0 0 0 0
4 17 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
S SKP 5
ID LBF14000BC07
FORMULA C15H30O2
EXACTMASS 242.22458020399998
AVERAGEMASS 242.3975
SMILES CCCC(C)CCCCCCCCCC(O)=O
M END
